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MCULE-8613496522-0
Structure
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
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Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 255 USD | 95 | 19 working days | Get Quote |
| 5 mg | 255 USD | 95 | 19 working days | Get Quote |
| 10 mg | 413 USD | N/A | 9 working days | Get Quote |
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1
MCULE-2485078651-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8613496522-0.sdf |
| SMILES | MCULE-8613496522-0.smiles |
| Standard InChI | MCULE-8613496522-0.inchi |
| InChIKey | MCULE-8613496522-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892954161 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-888170285 | Molnova | On demand | 98 | As is | by synthesis |
| P-611462159 | Toronto Research | In stock | 90 | As is | in stock |
| P-611491562 | Toronto Research | In stock | 90 | As is | in stock |
| P-893825083 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-893110041 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-867435090 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-890146633 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-894674706 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-864242146 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-854700166 | MedChemExpress | Screening compounds on demand | 95 | Main component | by synthesis |
| P-491319065 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-869120292 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-888635103 | TargetMol | Screening Compounds - stock amount | 95 | Main component | unavailable |
| P-611471694 | Toronto Research | In stock | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 429.909 |
| logP | 5.8213 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 9 |
| PSA | 49.77 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 118.4828 |
| Atoms | 55 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 25 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
